5-[2-[3-(2,5-dimethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]benzene-1,3-dicarboxamide

Systemtic Name: 5-[2-[3-(2,5-dimethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]benzene-1,3-dicarboxamide Openeye Name: 5-[[2-[3-(2,5-dimethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]amino]benzene-1,3-dicarboxamide CAS Name: 5-[[2-[[3-(2,5-dimethoxyphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]amino]benzene-1,3-dicarboxamide IUPAC Name: 5-[[2-[3-(2,5-dimethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]amino]benzene-1,3-dicarboxamide Traditional Name: 5-[[2-[[3-(2,5-dimethoxyphenyl)-4-keto-quinazolin-2-yl]thio]acetyl]amino]isophthalamide Formula: C26H23N5O6S MolecularWeight: 533.55572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC(=C4)C(=O)N)C(=O)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC(=C4)C(=O)N)C(=O)N

InChI

InChI=1S/C26H23N5O6S/c1-36-17-7-8-21(37-2)20(12-17)31-25(35)18-5-3-4-6-19(18)30-26(31)38-13-22(32)29-16-10-14(23(27)33)9-15(11-16)24(28)34/h3-12H,13H2,1-2H3,(H2,27,33)(H2,28,34)(H,29,32)